N-(1-adamantyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide

C20H26N2O3 — CID 7663754

IUPACN-(1-adamantyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide
SMILESCOc1ccccc1/C=N\OCC(=O)NC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C20H26N2O3/c1-24-18-5-3-2-4-17(18)12-21-25-13-19(23)22-20-9-14-6-15(10-20)8-16(7-14)11-20/h2-5,12,14-16H,6-11,13H2,1H3,(H,22,23)/b21-12-
InChIKeyQGPPDOADHCYOIU-MTJSOVHGSA-N
MW342.44 g/mol
LogP3.13
Rot. Bonds6

About N-(1-adamantyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide

N-(1-adamantyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide (PubChem CID 7663754) has the molecular formula C20H26N2O3 and a molecular weight of 342.44 g/mol. Its IUPAC name is N-(1-adamantyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide.

Molecular Properties

Compound NameN-(1-adamantyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide
PubChem CID7663754
Molecular FormulaC20H26N2O3
Molecular Weight342.44 g/mol
Exact Mass342.19
IUPAC NameN-(1-adamantyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide
SMILESCOc1ccccc1/C=N\OCC(=O)NC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C20H26N2O3/c1-24-18-5-3-2-4-17(18)12-21-25-13-19(23)22-20-9-14-6-15(10-20)8-16(7-14)11-20/h2-5,12,14-16H,6-11,13H2,1H3,(H,22,23)/b21-12-
InChIKeyQGPPDOADHCYOIU-MTJSOVHGSA-N
XLogP3.13
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(1-adamantyl)-2-[(Z)-(4-methylphenyl)methylideneamino]oxyacetamide
CID 7705203
N-[(2R)-butan-2-yl]-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide
CID 7664433
N-(1-adamantyl)-2-(2-hydroxyphenoxy)acetamide
CID 78773695
2-[(Z)-(2-methoxyphenyl)methylideneamino]oxy-N-(2,4,6-trimethylphenyl)acetamide
CID 7664139
2-[(Z)-(2-methoxyphenyl)methylideneamino]oxy-N-(2,4,5-trichlorophenyl)acetamide
CID 7664016
2-[(Z)-(2-methoxyphenyl)methylideneamino]oxy-N-(4-phenyldiazenylphenyl)acetamide
CID 7664217
methyl 4-[[[2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetyl]amino]methyl]benzoate
CID 7664095
N-(1-adamantyl)-2-[[amino-(4-methoxyphenyl)methylidene]amino]oxyacetamide
CID 75136185
N-(1-adamantyl)-2-(2-phenylphenoxy)acetamide
CID 7732550
N-(1-adamantyl)-2-(5-formyl-2-methoxyphenoxy)acetamide
CID 7611574
N-(1-adamantyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide
CID 3901343
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide
CID 7663932

Frequently Asked Questions

What is the IUPAC name of N-(1-adamantyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide?
The IUPAC name of N-(1-adamantyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide (CID 7663754) is N-(1-adamantyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide.
What is the SMILES notation for N-(1-adamantyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide?
The canonical SMILES for N-(1-adamantyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide is COc1ccccc1/C=N\OCC(=O)NC12CC3CC(CC(C3)C1)C2.
What is the InChIKey of N-(1-adamantyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide?
The InChIKey is QGPPDOADHCYOIU-MTJSOVHGSA-N. The full InChI is InChI=1S/C20H26N2O3/c1-24-18-5-3-2-4-17(18)12-21-25-13-19(23)22-20-9-14-6-15(10-20)8-16(7-14)11-20/h2-5,12,14-16H,6-11,13H2,1H3,(H,22,23)/b21-12-.
What are the key properties of N-(1-adamantyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide?
N-(1-adamantyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide has a molecular weight of 342.44 g/mol, XLogP of 3.13, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-adamantyl)-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide is sourced from PubChem (CID 7663754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).